1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate
TL;DR: 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate (CAS 99129-29-0) is a chemical compound with molecular formula C31H54O15 and molecular weight 666.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid;nonanoic acid;propane-1,2,3-triol
Also Known As: 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate, C9-H18-O2.x-(C8H6-O4.C6-H10-O4.C5-H12-O2.C3-H8-O3)x-, 1,3-Benzenedicarboxylic Acid, Polymer With 2,2-Dimethyl-1,3-Propanediol, Hexanedioic Acid And 1,2,3-, benzene-1,3-dicarboxylic acid; 2,2-dimethylpropane-1,3-diol; hexanedioic acid; nonanoic acid; propane-1,2,3-triol
| Molecular Formula | C31H54O15 |
|---|---|
| Molecular Weight | 666.35 g/mol |
| LogP | 2.9497 |
| Topological Polar Surface Area | 288.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 18 |
| Exact Mass | 666.34625 |
| Heavy Atoms | 46 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 99129-29-0 |
|---|---|
| SMILES | CCCCCCCCC(=O)O.CC(C)(CO)CO.C1=CC(=CC(=C1)C(=O)O)C(=O)O.C(CCC(=O)O)CC(=O)O.C(C(CO)O)O |
| InChIKey | OTBZSVSKEFTKRO-UHFFFAOYSA-N |
Product Overview
1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate (CAS 99129-29-0), with molecular formula C31H54O15 and molecular weight 666.35 g/mol. IUPAC: benzene-1,3-dicarboxylic acid;2,2-dimethylpropane-1,3-diol;hexanedioic acid;nonanoic acid;propane-1,2,3-triol.
Chemical Property Profile of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate
Property Insights of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate
The XLogP value of 2.9497 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate. The TPSA of 288.0 Ų indicates high polarity, suggesting 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate has 10 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate?
The CAS number of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate is 99129-29-0.
What is the molecular formula of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate?
The molecular formula of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate is C31H54O15.
What is the molecular weight of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate?
The molecular weight of 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate is 666.35 g/mol.
Where can I buy 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate?
You can request a quote for 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenedicarboxylic acid, polymer with 2,2-dimethyl-1,3-propanediol, hexanedioic acid and 1,2,3-propanetriol, nonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.